2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-(3-phenylpropyl)acetamide
Chemical Structure Depiction of
2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-(3-phenylpropyl)acetamide
2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-(3-phenylpropyl)acetamide
Compound characteristics
| Compound ID: | G290-0059 |
| Compound Name: | 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-(3-phenylpropyl)acetamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Smiles: | C(Cc1ccccc1)CNC(CN1C(c2cccnc2Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0146 |
| logD: | 4.0146 |
| logSw: | -4.336 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.766 |
| InChI Key: | MPPWHBKTTCYVFQ-UHFFFAOYSA-N |